Geometry & MOs

Info

ID:	15933
PubChem CID:	455601
Reduced:	PSN3O7C14H22 (1)
Stoich.:	ABC3D7E14F22 (1)
Weight, g/mol:	407.091608
ΔH_f, kcal/mol:	-347.69
Dipole, Da:	6.2
IP(EA), eV:	-9.23(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl 2-diethoxyphosphorylacetate

Drug info:

PubChemData

Smile

CCOP(=O)(CC(=O)OC[C@H]1O[C@H](CS1)N2C=CC(=NC2=O)N)OCC

DOS

IR

Vibrations